4-[furan-2-ylmethyl(phenethyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[furan-2-ylmethyl(phenethyl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-furylmethyl(phenethyl)amino]-4-oxo-butanoate CAS Name: 4-[2-furanylmethyl(phenethyl)amino]-4-oxobutanoate IUPAC Name: 4-[furan-2-ylmethyl(phenethyl)amino]-4-oxobutanoate Traditional Name: 4-[2-furfuryl(phenethyl)amino]-4-keto-butyrate Formula: C17H18NO4- MolecularWeight: 300.32912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CO2)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CO2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C17H19NO4/c19-16(8-9-17(20)21)18(13-15-7-4-12-22-15)11-10-14-5-2-1-3-6-14/h1-7,12H,8-11,13H2,(H,20,21)/p-1